SCHEMBL9768384

SCHEMBL9768384

CC(C)C1(c2ccccc2OCC#CCCl)Sc2ccccc2N(C)C1=O

nearest known ligand 0.34

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
RAD52 P43351 1/20 0.34
ALDH1A1 P00352 1/20 0.31
MAPT P10636 1/20 0.31
PKM P14618 1/20 0.31

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL9768382 1.00 RAD52 (0.34) RAD52ALDH1A1MAPTPKM
SCHEMBL10771121 0.80 RAD52 (0.35) RAD52ALDH1A1MAPTPKM
SCHEMBL10569643 0.78 ALDH1A1 (0.41) RAD52ALDH1A1MAPTPKM
SCHEMBL9768339 0.73 RAD52 (0.42) RAD52ALDH1A1MAPTPKM
SCHEMBL10572167 0.73 RAD52 (0.42) RAD52ALDH1A1MAPTPKM
Hydrochloric Acid SCHEMBL10773272 0.72 HIF1A (0.33) RAD52MAPT
SCHEMBL10770978 0.71 DRD2 (0.40) RAD52ALDH1A1
SCHEMBL10710825 0.69 KDM4E (0.40) ALDH1A1
Iprotiazem SCHEMBL10855448 0.69 HTR1A (0.40) ALDH1A1
Iprotiazem SCHEMBL2110235 0.69 HTR1A (0.40) ALDH1A1

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5025010-A Benzothiazinone derivatives, and pharmaceuticals containing them HOECHST AKTIENGESELLSCHAFT (DE) 1991-06-18 US disclosed